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CHEBI:211972 - Rufomyzaine

ChEBI IDCHEBI:211972
ChEBI NameRufomyzaine
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SubmitterMetaboLights
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FormulaC23H31N3O2
Net Charge0
Average Mass381.520
Monoisotopic Mass381.24163
SMILESC=CC(C)(C)n1cc(C[C@@H]2NC(=O)[C@H](CC(C)C)N(C)C2=O)c2ccccc21
InChIInChI=1S/C23H31N3O2/c1-7-23(4,5)26-14-16(17-10-8-9-11-19(17)26)13-18-22(28)25(6)20(12-15(2)3)21(27)24-18/h7-11,14-15,18,20H,1,12-13H2,2-6H3,(H,24,27)/t18-,20-/m0/s1
InChIKeyFSZDKCYBRSEERX-ICSRJNTNSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (29792329)
ChEBI Ontology
Outgoing Relation(s)
Rufomyzaine (CHEBI:211972) has functional parent α-amino acid (CHEBI:33704)
Rufomyzaine (CHEBI:211972) is a organonitrogen compound (CHEBI:35352)
Rufomyzaine (CHEBI:211972) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
(3S,6S)-1-methyl-3-[[1-(2-methylbut-3-en-2-yl)indol-3-yl]methyl]-6-(2-methylpropyl)piperazine-2,5-dione